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Details

Stereochemistry RACEMIC
Molecular Formula C16H20N2O3
Molecular Weight 288.3416
Optical Activity ( + / - )
Defined Stereocenters 0 / 1
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of METHYL 6-(4-ISOPROPYL-4-METHYL-5-OXO-2-IMIDAZOLIN-2-YL)-M-TOLUATE

SMILES

COC(=O)C1=CC(C)=CC=C1C2=NC(C)(C(C)C)C(=O)N2

InChI

InChIKey=TYIHVCIQMMTVHE-UHFFFAOYSA-N
InChI=1S/C16H20N2O3/c1-9(2)16(4)15(20)17-13(18-16)11-7-6-10(3)8-12(11)14(19)21-5/h6-9H,1-5H3,(H,17,18,20)

HIDE SMILES / InChI

Molecular Formula C16H20N2O3
Molecular Weight 288.3416
Charge 0
Count
Stereochemistry RACEMIC
Additional Stereochemistry No
Defined Stereocenters 0 / 1
E/Z Centers 0
Optical Activity ( + / - )

Approval Year

PubMed

PubMed

TitleDatePubMed
Protonation-dissociation reactions of imazamethabenz-methyl and imazamethabenz-Acid in relation to their soil sorption and abiotic degradation.
2009 Dec 9
Substance Class Chemical
Created
by admin
on Sat Dec 16 09:04:21 GMT 2023
Edited
by admin
on Sat Dec 16 09:04:21 GMT 2023
Record UNII
546J470WFK
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
METHYL 6-(4-ISOPROPYL-4-METHYL-5-OXO-2-IMIDAZOLIN-2-YL)-M-TOLUATE
Systematic Name English
BENZOIC ACID, 2-(4,5-DIHYDRO-4-METHYL-4-(1-METHYLETHYL)-5- OXO-1H-IMIDAZOL-2-YL)-5-METHYL-, METHYL ESTER
Systematic Name English
Code System Code Type Description
CAS
69969-62-6
Created by admin on Sat Dec 16 09:04:21 GMT 2023 , Edited by admin on Sat Dec 16 09:04:21 GMT 2023
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EPA CompTox
DTXSID80274060
Created by admin on Sat Dec 16 09:04:21 GMT 2023 , Edited by admin on Sat Dec 16 09:04:21 GMT 2023
PRIMARY
FDA UNII
546J470WFK
Created by admin on Sat Dec 16 09:04:21 GMT 2023 , Edited by admin on Sat Dec 16 09:04:21 GMT 2023
PRIMARY
PUBCHEM
94654
Created by admin on Sat Dec 16 09:04:21 GMT 2023 , Edited by admin on Sat Dec 16 09:04:21 GMT 2023
PRIMARY